200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 19098-69-2
19098-69-2 | 2-Propenoic acid, 2-cyano-3-(3-methoxyphenyl)-, ethyl ester
CAS No: 19098-69-2 Catalog No: AG002EYR MDL No:
Product Description
Catalog Number:
AG002EYR
Chemical Name:
2-Propenoic acid, 2-cyano-3-(3-methoxyphenyl)-, ethyl ester
CAS Number:
19098-69-2
Molecular Formula:
C13H13NO3
Molecular Weight:
231.2472
IUPAC Name:
ethyl 2-cyano-3-(3-methoxyphenyl)prop-2-enoate
InChI:
InChI=1S/C13H13NO3/c1-3-17-13(15)11(9-14)7-10-5-4-6-12(8-10)16-2/h4-8H,3H2,1-2H3
InChI Key:
LHWAGIDKCSEUAT-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=Cc1cccc(c1)OC)C#N
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.09g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.251g/mol
Monoisotopic Mass:
231.09g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
59.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.7
Related Products
© 2019 Angene International Limited. All rights Reserved.